KEGG:C12206 Caffeyl alcohol ISISHOST07080423302D 1 1.00000 0.00000 14534 12 12 0 0 0 999 V2000 -1.5155 -2.6319 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7902 -2.2116 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5155 -3.4552 0.0000 O 0 0 0 0 0 0 0 0 0 -2.2305 -2.2116 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7902 -1.3780 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0760 -2.6216 0.0000 O 0 0 0 0 0 0 0 0 0 -2.2305 -1.3780 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5155 -0.9647 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5155 -0.1414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8047 0.2754 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8090 1.1015 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5242 1.5108 0.0000 O 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 2 5 2 0 0 0 2 6 1 0 0 0 4 7 1 0 0 0 5 8 1 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 7 8 2 0 0 0 1 2 1 0 0 0 10 11 1 0 0 0 1 3 1 0 0 0 11 12 1 0 0 0 M END